2,7-dimethyl-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]quinoline-3-carboxamide

Systemtic Name: 2,7-dimethyl-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]quinoline-3-carboxamide Openeye Name: 2,7-dimethyl-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]quinoline-3-carboxamide CAS Name: 2,7-dimethyl-N-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl]-3-quinolinecarboxamide IUPAC Name: 2,7-dimethyl-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]quinoline-3-carboxamide Traditional Name: 2,7-dimethyl-N-[3-[4-(2-pyrimidyl)piperazino]propyl]quinoline-3-carboxamide Formula: C23H28N6O MolecularWeight: 404.50802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(C=C2C=C1)C(=O)NCCCN3CCN(CC3)C4=NC=CC=N4)C

Isomeric SMILES

CC1=CC2=NC(=C(C=C2C=C1)C(=O)NCCCN3CCN(CC3)C4=NC=CC=N4)C

InChI

InChI=1S/C23H28N6O/c1-17-5-6-19-16-20(18(2)27-21(19)15-17)22(30)24-9-4-10-28-11-13-29(14-12-28)23-25-7-3-8-26-23/h3,5-8,15-16H,4,9-14H2,1-2H3,(H,24,30)